首页|基于网络药理学和分子对接分析虎贯茵黄清肝饮治疗乙型病毒性肝炎的作用机制

基于网络药理学和分子对接分析虎贯茵黄清肝饮治疗乙型病毒性肝炎的作用机制

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目的:应用网络药理学及分子对接技术对虎贯茵黄清肝饮治疗乙型病毒性肝炎的活性成分、靶点和作用通路进行分析.方法:通过多个公共数据库获得虎贯茵黄清肝饮中活性成分的潜在靶点和乙型病毒性肝炎的疾病靶点,获得二者的交集靶点,对交集靶点进行基因本体论(GO)功能富集分析和京都基因与基因组百科全书(KEGG)通路富集分析,并将关键靶点与重要活性成分进行分子对接.结果:通过网络药理学分析获得有效活性成分206个、有效活性成分靶点405个、疾病靶点1431个、有效活性成分-疾病交集靶点120个、关键靶点12个.富集的KEGG通路有磷脂酰肌醇3激酶-蛋白激酶B信号通路、癌症通路、缺氧诱导因子-1信号通路等.分子对接显示,核心成分与关键靶点能有效结合.结论:虎贯茵黄清肝饮可能通过细胞凋亡过程的负调节、对异生刺激的反应、基因表达的正向调控、信号转导等作用机制,达到治疗乙型病毒性肝炎的作用.
The action mechanism of Huguan Yinhuang Qinggan Yin in treating viral hepatitis B based on network pharmacology and molecular docking
Objective:Through network pharmacology and molecular docking technology,the active components,targets and action pathways of Huguan Yinhuang Qinggan Yin(虎贯茵黄清肝饮)in the treatment of virus B hepatitis were analyzed.Methods:The potential targets of the active ingredients in Huguan Yinhuang Qinggan Yin and the disease targets of viral hepatitis B were obtained through multiple public databases,and the intersection targets of the two were obtained.GO functional enrichment analysis and KEGG pathway enrichment analysis of the intersection targets were performed.The key targets and important active ingredients were analyzed by molecular docking.Results:Network pharmacology analysis obtained 206 effective active ingredients,405 targets of effective active ingredients,1 431 disease targets,120 intersection targets of effevtiue active ingredients and disease,and 12 key targets.The enriched KEGG pathways included PI3K-Akt signaling pathway,cancer pathway,HIF-1 signaling pathway,etc.Molecular docking showed that the core components could effectively combine with key targets.Conclusion:Huguan Yinhuang Qinggan Yin can treat virus B hepatitis through negative regulation of apoptosis,response to xenobiotic stimuli,positive regulation of gene expression,signal transduction and other mechanisms.

Huguan Yinhuang Qinggan YinVirus B hepatitisNetwork pharmacologyMolecular dockingAction mechanism

覃素萍、李小敏、蓝小梅、吴奕霖、吴长亮

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广西中医药大学,广西 南宁,530200

广西国际壮医医院,广西 南宁,530029

虎贯茵黄清肝饮 乙型病毒性肝炎 网络药理学 分子对接 作用机制

2024

中医临床研究
中华中医药学会

中医临床研究

影响因子:0.839
ISSN:1674-7860
年,卷(期):2024.16(29)